O1-tert-butyl O3-(5-fluoranyl-2-nitro-phenyl) (3R)-piperidine-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-(5-fluoranyl-2-nitro-phenyl) (3R)-piperidine-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-(5-fluoro-2-nitro-phenyl) (3R)-piperidine-1,3-dicarboxylate CAS Name: (3R)-piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-(5-fluoro-2-nitrophenyl) ester IUPAC Name: 1-O-tert-butyl 3-O-(5-fluoro-2-nitrophenyl) (3R)-piperidine-1,3-dicarboxylate Traditional Name: (3R)-piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-(5-fluoro-2-nitro-phenyl) ester Formula: C17H21FN2O6 MolecularWeight: 368.356843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H](C1)C(=O)OC2=C(C=CC(=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H21FN2O6/c1-17(2,3)26-16(22)19-8-4-5-11(10-19)15(21)25-14-9-12(18)6-7-13(14)20(23)24/h6-7,9,11H,4-5,8,10H2,1-3H3/t11-/m1/s1